6-fluoro-2,3-dihydro-1H-quinolin-4-one

C9H8FNO — CID 11423781

IUPAC6-fluoro-2,3-dihydro-1H-quinolin-4-one
SMILESO=C1CCNc2ccc(F)cc21
InChIInChI=1S/C9H8FNO/c10-6-1-2-8-7(5-6)9(12)3-4-11-8/h1-2,5,11H,3-4H2
InChIKeyFTSMXKUXNFFCGG-UHFFFAOYSA-N
MW165.17 g/mol
LogP1.82
Rot. Bonds

About 6-fluoro-2,3-dihydro-1H-quinolin-4-one

6-fluoro-2,3-dihydro-1H-quinolin-4-one (PubChem CID 11423781) has the molecular formula C9H8FNO and a molecular weight of 165.17 g/mol. Its IUPAC name is 6-fluoro-2,3-dihydro-1H-quinolin-4-one.

Molecular Properties

Compound Name6-fluoro-2,3-dihydro-1H-quinolin-4-one
PubChem CID11423781
Molecular FormulaC9H8FNO
Molecular Weight165.17 g/mol
Exact Mass165.06
IUPAC Name6-fluoro-2,3-dihydro-1H-quinolin-4-one
SMILESO=C1CCNc2ccc(F)cc21
InChIInChI=1S/C9H8FNO/c10-6-1-2-8-7(5-6)9(12)3-4-11-8/h1-2,5,11H,3-4H2
InChIKeyFTSMXKUXNFFCGG-UHFFFAOYSA-N
XLogP1.82
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.17
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 736140
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CID 6748
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CID 69089
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CID 67582
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CID 6124753
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CID 10063343
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CID 419818
CID 419818

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2,3-dihydro-1H-quinolin-4-one?
The IUPAC name of 6-fluoro-2,3-dihydro-1H-quinolin-4-one (CID 11423781) is 6-fluoro-2,3-dihydro-1H-quinolin-4-one.
What is the SMILES notation for 6-fluoro-2,3-dihydro-1H-quinolin-4-one?
The canonical SMILES for 6-fluoro-2,3-dihydro-1H-quinolin-4-one is O=C1CCNc2ccc(F)cc21.
What is the InChIKey of 6-fluoro-2,3-dihydro-1H-quinolin-4-one?
The InChIKey is FTSMXKUXNFFCGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FNO/c10-6-1-2-8-7(5-6)9(12)3-4-11-8/h1-2,5,11H,3-4H2.
What are the key properties of 6-fluoro-2,3-dihydro-1H-quinolin-4-one?
6-fluoro-2,3-dihydro-1H-quinolin-4-one has a molecular weight of 165.17 g/mol, XLogP of 1.82, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2,3-dihydro-1H-quinolin-4-one is sourced from PubChem (CID 11423781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).